Compound Identification
SMILES
OC1NC2=C(I)C=C(I)C=C2C(=O)N2C=CC=C12
InChIKey
InChIKey=XBMVBNYIWWABEC-UHFFFAOYSA-N
Formula
C12H8I2N2O2
Mass
466.017
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Secondary alkylarylamines Benzenoids Aryl iodides Vinylogous amides Pyrroles Heteroaromatic compounds Lactams Azacyclic compounds Alkanolamines Organopnictogen compounds Organooxygen compounds Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Secondary aliphatic/aromatic amine - Benzenoid - Aryl iodide - Aryl halide - Heteroaromatic compound - Vinylogous amide - Pyrrole - Lactam - Azacycle - Secondary amine - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.
External Descriptors
Not available